tert-butyl 4-[1-(4-nitrophenyl)-4-{[(pyridin-3-yl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(4-nitrophenyl)-4-{[(pyridin-3-yl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(4-nitrophenyl)-4-{[(pyridin-3-yl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1259 |
| Compound Name: | tert-butyl 4-[1-(4-nitrophenyl)-4-{[(pyridin-3-yl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 506.56 |
| Molecular Formula: | C26 H30 N6 O5 |
| Smiles: | CC(C)(C)OC(N1CCC(CC1)c1c(cnn1c1ccc(cc1)[N+]([O-])=O)C(NCc1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6108 |
| logD: | 4.6107 |
| logSw: | -4.0955 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.456 |
| InChI Key: | QFMVHAXRNZQSEK-UHFFFAOYSA-N |